Isophthalic Acid

Isophthalic Acid

SCHEMBL459728

CCNCC.O=C(O)c1cccc(C(=O)O)c1

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CCKAR

The experimentally established mechanism targets of Isophthalic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA6 P23280 1/20 0.52
CA9 Q16790 1/20 0.52
UNG P13051 1/20 0.52
KMT2A Q03164 2/20 0.51
FOLH1 Q04609 1/20 0.50
PKM P14618 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
HPGD P15428 2/20 0.48
KMO O15229 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
HSD17B10 Q99714 1/20 0.48
MEP1B Q16820 1/20 0.47
MEN1 O00255 1/20 0.47
AKR1C3 P42330 1/20 0.47
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Diethylamine SCHEMBL1028475 0.89 SMN1; SMN2 (0.54) KMT2AHPGDMEN1AKR1C3ALDH1A1
Isophthalic Acid SCHEMBL27573445 0.88 CA12 (0.52) CA12CA1CA2CA6CA9
Benzoic Acid SCHEMBL64441 0.87 TSHR (0.64) KMT2AHPGDMEN1KDM4EALDH1A1
Isophthalic Acid SCHEMBL9575080 0.87 CA12 (0.60) CA12CA1CA2CA6CA9
Isophthalic Acid SCHEMBL1483205 0.85 KMT2A (0.61) CA12CA1CA2CA6CA9
SCHEMBL16366609 0.83 MEP1B (0.65) CA1CA2UNGFOLH1PKM
SCHEMBL13702421 0.82 SMN1; SMN2 (0.59) KMT2APKML3MBTL1CYP1A2HSD17B10
Terephthalic Acid SCHEMBL31728724 0.82 ALDH1A1 (0.60) CA12CA1CA2CA6CA9
Isophthalic Acid SCHEMBL680956 0.82 CA12 (0.60) CA12CA1CA2CA6CA9
Isophthalic Acid SCHEMBL28375462 0.82 CA12 (0.60) CA12CA1CA2CA6CA9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 252 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112955498-B Polybenzimidazole (PBI) membrane for redox flow battery 南卡罗来纳大学 2024-05-10 CN claimed
EP-3850698-A2 LOW PERMEABILITY POLYBENZIMIDAZOLE (PBI) MEMBRANES FOR REDOX FLOW BATTERIES University of South Carolina (US) 2021-07-21 EP claimed
EP-3850697-A1 POLYBENZIMIDAZOLE (PBI) MEMBRANES FOR REDOX FLOW BATTERIES University of South Carolina (US) 2021-07-21 EP claimed
CN-112955498-A Polybenzimidazole (PBI) membranes for redox flow batteries 南卡罗来纳大学 2021-06-11 CN claimed
CN-112956056-A Low permeability Polybenzimidazole (PBI) membranes for redox flow batteries 南卡罗来纳大学 2021-06-11 CN claimed
EP-2443176-B1 METHOD FOR THE PRODUCTION OF A HIGH-MOLECULAR POLYAZOLE BASF SE (DE) 2020-06-03 EP claimed
WO-2020056275-A1 POLYBENZIMIDAZOLE (PBI) MEMBRANES FOR REDOX FLOW BATTERIES UNIVERSITY OF SOUTH CAROLINA (US) 2020-03-19 WO claimed
WO-2020056268-A2 LOW PERMEABILITY POLYBENZIMIDAZOLE (PBI) MEMBRANES FOR REDOX FLOW BATTERIES UNIVERSITY OF SOUTH CAROLINA (US) 2020-03-19 WO claimed
EP-2804889-B1 PROTON-CONDUCTING MEMBRANE, METHOD FOR THEIR PRODUCTION AND THEIR USE IN ELECTROCHEMICAL CELLS BASF SE (DE) 2019-03-13 EP claimed
US-20180123155-A1 PROTON-CONDUCTING MEMBRANE, METHOD FOR THEIR PRODUCTION AND THEIR USE IN ELECTROCHEMICAL CELLS BASF SE (DE) 2018-05-03 US claimed
US-20060057449-A1 Proton-conducting membrane and the use thereof BASF FUEL CELL GMBH (DE) 2006-03-16 US claimed
US-20060035095-A1 Proton-conducting membrane and use thereof verwendung PEMEAS GMBH (DE) 2006-02-16 US claimed
US-20060008690-A1 Proton conducting polymer membrane comprising phoshphonic acid groups containing polyazoles and the use thereof in fuel cells BASF FUEL CELL GMBH (DE) 2006-01-12 US claimed
EP-1527493-B1 PROTON-CONDUCTING POLYMER MEMBRANE COMPRISING A POLYMER WITH PHOSPHONIC ACID GROUPS AND USE THEREOF IN FUEL CELLS PEMEAS GMBH (DE) 2006-01-04 EP claimed
EP-1527494-B1 PROTON-CONDUCTING POLYMER MEMBRANE COMPRISING A POLYMER WITH SULPHONIC ACID GROUPS AND USE THEREOF IN FUEL CELLS PEMEAS GMBH (DE) 2005-12-28 EP claimed
US-20050256296-A1 Polymer film based on polyazoles, and uses thereof BASF FUEL CELL GMBH (DE) 2005-11-17 US claimed
US-20050244694-A1 Proton-conducting polymer membrane comprising polymers containing phosphonic acid groups and its use in fuel cells PEMEAS GMBH (DE) 2005-11-03 US claimed
US-20050244695-A1 vinyl-containing sulfonic acid polymerized in presence of one or more aromatic tetraamino compounds and with one or more aromatic carboxylic acids, their esters, their acid halides or their acid anhydrides; interpenetrating polymer network BASF FUEL CELL GMBH (DE) 2005-11-03 US claimed
US-20040127588-A1 Proton-conducting membrane and use thereof BASF FUEL CELL GMBH (DE) 2004-07-01 US claimed
US-20040096734-A1 Proton-comducting membrane and the use thereof BASF FUEL CELL GMBH (DE) 2004-05-20 US claimed